2-(1,2-dimethyl-9-oxidanylidene-thioxanthen-4-yl)oxyethanoic acid

Systemtic Name: 2-(1,2-dimethyl-9-oxidanylidene-thioxanthen-4-yl)oxyethanoic acid Openeye Name: 2-(1,2-dimethyl-9-oxo-thioxanthen-4-yl)oxyacetic acid CAS Name: 2-[(1,2-dimethyl-9-oxo-4-thioxanthenyl)oxy]acetic acid IUPAC Name: 2-(1,2-dimethyl-9-oxothioxanthen-4-yl)oxyacetic acid Traditional Name: 2-(9-keto-1,2-dimethyl-thioxanthen-4-yl)oxyacetic acid Formula: C17H14O4S MolecularWeight: 314.35566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)C(=O)C3=CC=CC=C3S2)OCC(=O)O

Isomeric SMILES

CC1=CC(=C2C(=C1C)C(=O)C3=CC=CC=C3S2)OCC(=O)O

InChI

InChI=1S/C17H14O4S/c1-9-7-12(21-8-14(18)19)17-15(10(9)2)16(20)11-5-3-4-6-13(11)22-17/h3-7H,8H2,1-2H3,(H,18,19)